SCHEMBL7977243

SCHEMBL7977243

CCn1c2ccc(C#N)cc2c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.67
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
LMNA P02545 1/20 0.67
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.47
RORC P51449 5/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KCNJ1 P48048 1/20 0.44
KCNH2 Q12809 1/20 0.44
NQO2 P16083 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7976962 0.91 MAPT (0.56) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL29539965 0.87 MAPT (0.85) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL148001 0.87 MAPT (0.85) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL21076080 0.84 RORC (0.52) MAPTMEN1KMT2ARORC
SCHEMBL28710625 0.81 MAPT (0.81) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL29767664 0.81 MAPT (0.81) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL29666347 0.80 MAPT (1.00) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL149167 0.80 MAPT (1.00) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL16295058 0.79 MAPT (0.72) MAPTMEN1KMT2ALMNACYP1A2
SCHEMBL16412008 0.78 MAPT (0.67) MAPTMEN1KMT2ALMNACYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed